cyclohexylmethyl 4-methylidene-2-oxidanylidene-6-(3-phenylmethoxyphenyl)-1,3-diazinane-5-carboxylate

Systemtic Name: cyclohexylmethyl 4-methylidene-2-oxidanylidene-6-(3-phenylmethoxyphenyl)-1,3-diazinane-5-carboxylate Openeye Name: cyclohexylmethyl 4-(3-benzyloxyphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-methylene-2-oxo-6-(3-phenylmethoxyphenyl)-1,3-diazinane-5-carboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 4-methylidene-2-oxo-6-(3-phenylmethoxyphenyl)-1,3-diazinane-5-carboxylate Traditional Name: 4-(3-benzoxyphenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid cyclohexylmethyl ester Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=O)N1)C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)OCC4CCCCC4

Isomeric SMILES

C=C1C(C(NC(=O)N1)C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)OCC4CCCCC4

InChI

InChI=1S/C26H30N2O4/c1-18-23(25(29)32-17-20-11-6-3-7-12-20)24(28-26(30)27-18)21-13-8-14-22(15-21)31-16-19-9-4-2-5-10-19/h2,4-5,8-10,13-15,20,23-24H,1,3,6-7,11-12,16-17H2,(H2,27,28,30)